tert-butyl 4-[[2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]phenyl]carbonylamino]-2-methyl-benzimidazole-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-methoxy-4-[(3-methyl-4-oxidanylidene-2,5-dihydro-1,3-benzodiazepin-1-yl)carbonyl]phenyl]carbonylamino]-2-methyl-benzimidazole-1-carboxylate Openeye Name: tert-butyl 4-[[2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoyl]amino]-2-methyl-benzimidazole-1-carboxylate CAS Name: 4-[[[2-methoxy-4-[(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepin-1-yl)-oxomethyl]phenyl]-oxomethyl]amino]-2-methyl-1-benzimidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[2-methoxy-4-(3-methyl-4-oxo-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)benzoyl]amino]-2-methylbenzimidazole-1-carboxylate Traditional Name: 4-[[4-(4-keto-3-methyl-2,5-dihydro-1,3-benzodiazepine-1-carbonyl)-2-methoxy-benzoyl]amino]-2-methyl-benzimidazole-1-carboxylic acid tert-butyl ester Formula: C32H33N5O6 MolecularWeight: 583.63432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C(=O)OC(C)(C)C)C=CC=C2NC(=O)C3=C(C=C(C=C3)C(=O)N4CN(C(=O)CC5=CC=CC=C54)C)OC

Isomeric SMILES

CC1=NC2=C(N1C(=O)OC(C)(C)C)C=CC=C2NC(=O)C3=C(C=C(C=C3)C(=O)N4CN(C(=O)CC5=CC=CC=C54)C)OC

InChI

InChI=1S/C32H33N5O6/c1-19-33-28-23(11-9-13-25(28)37(19)31(41)43-32(2,3)4)34-29(39)22-15-14-21(16-26(22)42-6)30(40)36-18-35(5)27(38)17-20-10-7-8-12-24(20)36/h7-16H,17-18H2,1-6H3,(H,34,39)